SCHEMBL17048360

SCHEMBL17048360

COc1cc2c3c(=O)c4ccc(C#N)cc4[nH]c3n(C(C)C)c2c(F)c1C1CCN(C(C)C)CC1

nearest known ligand 0.95

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.95
DAPK3 O43293 1/20 0.65
INSR P06213 1/20 0.65
INSRR P14616 1/20 0.65
LTK P29376 1/20 0.65
CLK1 P49759 1/20 0.65
DAPK1 P53355 1/20 0.65
MERTK Q12866 1/20 0.65
DAPK2 Q9UIK4 1/20 0.65

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17048359 0.98 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL17048283 0.91 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL17048257 0.89 ALK (0.96) ALKDAPK3INSRINSRRLTK
SCHEMBL18589044 0.87 ALK (0.82) ALKDAPK3INSRINSRRLTK
SCHEMBL17048124 0.87 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL17048256 0.87 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL20182828 0.86 ALK (0.83) ALKDAPK3INSRINSRRLTK
SCHEMBL17048388 0.86 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL17054322 0.86 ALK (0.80) ALKDAPK3INSRINSRRLTK
SCHEMBL18589151 0.85 ALK (0.78) ALKDAPK3INSRINSRRLTK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3110815-A1 INDOLOQUINOLONE COMPOUNDS AS ANAPLASTIC LYMPHOMA KINASE (ALK) INHIBITORS Jiangsu Ascentage Biomed Development Inc. (CN) 2017-01-04 EP disclosed
WO-2015127629-A1 INDOLOQUINOLONE COMPOUNDS AS ANAPLASTIC LYMPHOMA KINASE (ALK) INHIBITORS JIANGSU ASCENTAGE BIOMED DEVELOPMENT INC. (CN) 2015-09-03 WO disclosed